2-[[2,5-bis(decylcarbamoyl)phenyl]-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[[2,5-bis(decylcarbamoyl)phenyl]-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[N-(carboxymethyl)-2,5-bis(decylcarbamoyl)anilino]acetic acid CAS Name: 2-[N-(carboxymethyl)-2,5-bis[(decylamino)-oxomethyl]anilino]acetic acid IUPAC Name: 2-[N-(carboxymethyl)-2,5-bis(decylcarbamoyl)anilino]acetic acid Traditional Name: 2-[N-(carboxymethyl)-2,5-bis(decylcarbamoyl)anilino]acetic acid Formula: C32H53N3O6 MolecularWeight: 575.77972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC(=O)C1=CC(=C(C=C1)C(=O)NCCCCCCCCCC)N(CC(=O)O)CC(=O)O

Isomeric SMILES

CCCCCCCCCCNC(=O)C1=CC(=C(C=C1)C(=O)NCCCCCCCCCC)N(CC(=O)O)CC(=O)O

InChI

InChI=1S/C32H53N3O6/c1-3-5-7-9-11-13-15-17-21-33-31(40)26-19-20-27(28(23-26)35(24-29(36)37)25-30(38)39)32(41)34-22-18-16-14-12-10-8-6-4-2/h19-20,23H,3-18,21-22,24-25H2,1-2H3,(H,33,40)(H,34,41)(H,36,37)(H,38,39)